LIMITING LAW FOR ION ADSORPTION IN NARROW PLANAR PORES

被引:19
作者
BRATKO, D
HENDERSON, DJ
BLUM, L
机构
[1] UNIV UTAH, DEPT CHEM, SALT LAKE CITY, UT 84112 USA
[2] UNIV UTAH, UTAH SUPERCOMP INST IBM PARTNERSHIP, SALT LAKE CITY, UT 84112 USA
[3] UNIV PUERTO RICO, DEPT PHYS, SAN JUAN, PR 00931 USA
来源
PHYSICAL REVIEW A | 1991年 / 44卷 / 12期
关键词
D O I
10.1103/PhysRevA.44.8235
中图分类号
O43 [光学];
学科分类号
070207 ; 0803 ;
摘要
The adsorption of simple electrolytes in narrow planar pores is studied. The validity of the limiting law according to which the density of a classical ionic fluid approaches the fugacity in the pores barely exceeding the diameter of the ions is confirmed using the graphical expansion of the singlet-ion distribution. The same result emerges from the Kirkwood equation for the ion-wall correlation. The analysis is paralleled by the open-ensemble Monte Carlo simulation of the electrolyte in the pore, the periodic boundary conditions being implemented using the two-dimensional Ewald summation. The computations conform with theoretical predictions for extremely narrow slits and provide useful insights into the partitioning of the salt between the slit and the bulk solution at intermediate widths of the pores.
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页码:8235 / 8241
页数:7
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